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Current in silico methods for multi-target drug discovery in early anticancer research: the rise of the perturbation-theory machine learning approach.

Valeria V KleandrovaMaria Natália Dias Soeiro CordeiroAlejandro Speck-Planche
Published in: Future medicinal chemistry (2023)
Keyphrases
  • drug discovery
  • machine learning
  • molecular docking
  • artificial intelligence
  • big data
  • deep learning
  • molecular dynamics simulations